#------------------------------------------------------------------------------
#$Date: 2016-04-03 01:32:10 +0300 (Sun, 03 Apr 2016) $
#$Revision: 181063 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/21/43/2214342.hkl $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2214342_Fobs
loop_
_publ_author_name
'Zelinska, Mariya'
'Oryshchyn, Stepan'
'Zhak, Olga'
'Pivan, Jean-Yves'
'Potel, Michel'
'No\"el, Henri'
_publ_section_title
;
 Redetermination of Ni~5~P~4~
;
_journal_coeditor_code           MG2021
_journal_issue                   7
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i158
_journal_page_last               i159
_journal_volume                  63
_journal_year                    2007
_space_group_IT_number           186
_symmetry_space_group_name_Hall  'P 6c -2c'
_symmetry_space_group_name_H-M   'P 63 m c'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                120.000
_cell_length_a                   6.7921
_cell_length_b                   6.7921
_cell_length_c                   10.9922
_exptl_crystal_F_000             800.00
_reflns_d_resolution_high        0.5526
_cod_data_source_file            mg2021Isup2.hkl
_cod_data_source_block           I
#BEGIN Tags that were not found in dictionaries:
_shelx_title
'                                  import in P 63 m c'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            325.79
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, z+1/2'
'-y, x-y, z'
'-x+y, -x, z'
'x-y, x, z+1/2'
'y, -x+y, z+1/2'
'-x+y, y, z'
'x, x-y, z'
'-y, -x, z'
'y, x, z+1/2'
'-x, -x+y, z+1/2'
'x-y, -y, z+1/2'
loop_
_refln_index_h
_refln_index_k
_refln_index_l
_refln_F_squared_calc
_refln_F_squared_meas
_refln_F_squared_sigma
_refln_observed_status
0 1 -19 105.57 215.75 223.81 o
0 2 -19 533.38 331.94 246.95 o
-1 3 -19 16.16 88.10 135.41 o
0 3 -19 689.79 892.63 200.66 o
0 0 -18 322.18 44.00 366.24 o
0 1 -18 64.62 -90.93 127.39 o
-1 2 -18 20.98 -47.96 137.61 o
0 2 -18 5337.45 5577.10 166.34 o
-1 3 -18 838.39 768.22 101.91 o
0 3 -18 0.95 -141.89 141.89 o
-2 4 -18 275.28 135.09 187.74 o
-1 4 -18 750.39 827.96 125.09 o
0 4 -18 769.18 741.16 169.64 o
-2 5 -18 15.57 180.95 133.21 o
0 1 -17 1170.47 1203.88 94.59 o
0 2 -17 379.72 322.68 104.83 o
-1 3 -17 1620.73 1911.83 79.67 o
0 3 -17 1787.93 1762.37 132.07 o
-1 4 -17 8.09 224.21 102.75 o
0 4 -17 38.42 5.20 138.69 o
-2 5 -17 3456.48 3362.26 130.78 o
-1 5 -17 596.23 437.87 133.65 o
0 5 -17 2768.74 2429.70 200.50 o
-2 6 -17 2445.22 2379.10 156.25 o
0 0 -16 1558.66 1750.58 174.53 o
0 1 -16 64.63 9.28 78.94 o
-1 2 -16 293.33 326.47 95.93 o
0 2 -16 3931.94 4172.18 132.06 o
-1 3 -16 740.54 767.06 81.20 o
0 3 -16 233.63 166.24 120.14 o
-2 4 -16 749.53 671.83 120.17 o
-1 4 -16 969.48 1225.93 93.27 o
0 4 -16 334.78 380.52 144.87 o
-2 5 -16 219.84 278.46 100.16 o
-1 5 -16 229.42 229.55 102.72 o
0 5 -16 2095.72 1914.10 172.43 o
-3 6 -16 396.04 576.68 178.53 o
-2 6 -16 275.50 434.60 136.22 o
-1 6 -16 1086.82 982.63 151.34 o
0 6 -16 273.22 -133.30 203.03 o
-3 7 -16 311.76 160.61 170.52 o
-2 7 -16 160.32 152.23 149.05 o
0 1 -15 319.37 289.76 66.97 o
0 2 -15 1195.74 1087.37 79.95 o
-1 3 -15 208.26 257.14 65.13 o
0 3 -15 3505.51 3429.28 116.17 o
-1 4 -15 394.87 428.21 74.11 o
0 4 -15 185.30 155.70 130.03 o
-2 5 -15 554.34 547.41 86.03 o
-1 5 -15 576.92 440.10 98.85 o
0 5 -15 592.74 599.88 146.75 o
-2 6 -15 57.20 31.66 97.56 o
-1 6 -15 283.61 287.36 132.01 o
0 6 -15 1478.15 1518.67 229.21 o
-3 7 -15 126.77 146.74 155.20 o
-2 7 -15 919.64 1101.23 132.46 o
-1 7 -15 193.85 279.47 146.66 o
0 0 -14 30631.04 31303.08 467.47 o
0 1 -14 2603.63 2617.66 63.81 o
-1 2 -14 3934.70 3845.08 82.39 o
0 2 -14 469.39 476.45 63.95 o
-1 3 -14 128.02 271.24 52.70 o
0 3 -14 10449.93 10384.94 130.92 o
-2 4 -14 5409.49 5350.18 127.72 o
-1 4 -14 131.19 155.59 76.98 o
0 4 -14 8.37 6.96 123.59 o
-2 5 -14 4724.19 4789.38 97.02 o
-1 5 -14 1137.83 1187.16 82.28 o
0 5 -14 221.12 407.11 134.67 o
-3 6 -14 3625.00 3491.71 148.59 o
-2 6 -14 1433.78 1608.70 101.04 o
-1 6 -14 1071.62 1166.90 103.05 o
0 6 -14 1001.77 912.89 166.29 o
-3 7 -14 141.09 67.58 108.15 o
-2 7 -14 4814.69 4719.68 137.50 o
-1 7 -14 94.85 -79.27 107.73 o
0 7 -14 2141.20 2233.02 192.08 o
-4 8 -14 1117.86 699.47 235.46 o
-3 8 -14 1332.23 1416.04 158.07 o
-2 8 -14 352.46 297.58 160.26 o
-1 8 -14 931.06 801.46 152.12 o
0 1 -13 356.12 250.13 44.32 o
0 2 -13 57.82 26.00 52.01 o
-1 3 -13 1120.18 1128.80 42.58 o
0 3 -13 7581.37 7462.33 119.13 o
-1 4 -13 1059.03 1080.46 60.15 o
0 4 -13 769.30 572.64 75.54 o
-2 5 -13 1400.72 1343.43 64.08 o
-1 5 -13 946.39 955.65 67.92 o
0 5 -13 2753.35 2605.32 121.83 o
-2 6 -13 233.79 259.87 71.34 o
-1 6 -13 399.96 472.26 85.62 o
0 6 -13 3451.02 3105.88 159.24 o
-3 7 -13 409.01 469.58 89.36 o
-2 7 -13 1234.49 1371.67 102.94 o
-1 7 -13 315.98 193.37 100.83 o
0 7 -13 1343.09 1387.07 158.58 o
-3 8 -13 1032.66 1117.49 120.40 o
-2 8 -13 1997.33 1995.17 142.84 o
-1 8 -13 227.43 194.37 136.98 o
0 8 -13 158.58 246.80 211.38 o
-4 9 -13 191.10 359.34 149.18 o
-3 9 -13 1617.48 1827.66 145.49 o
0 0 -12 2498.26 2388.25 128.82 o
0 1 -12 448.36 450.90 45.52 o
-1 2 -12 182.30 217.45 53.31 o
0 2 -12 1831.95 1757.60 61.97 o
-1 3 -12 375.12 403.92 40.61 o
0 3 -12 746.98 796.71 68.69 o
-2 4 -12 129.86 45.62 54.27 o
-1 4 -12 882.94 852.65 41.41 o
0 4 -12 140.39 106.66 61.83 o
-2 5 -12 1041.37 1053.10 56.22 o
-1 5 -12 42.55 40.01 45.63 o
0 5 -12 1202.84 1250.71 94.32 o
-3 6 -12 974.09 1087.02 157.98 o
-2 6 -12 372.39 376.42 63.70 o
-1 6 -12 543.74 521.64 70.23 o
0 6 -12 336.34 176.60 103.37 o
-3 7 -12 16.78 -74.18 74.18 o
-2 7 -12 283.28 357.15 79.11 o
-1 7 -12 126.60 134.37 84.78 o
0 7 -12 529.69 558.85 143.69 o
-4 8 -12 331.05 686.31 148.02 o
-3 8 -12 970.41 896.14 96.30 o
-2 8 -12 430.65 430.41 101.09 o
-1 8 -12 197.83 256.34 119.60 o
0 8 -12 535.87 635.94 219.88 o
-4 9 -12 5.72 107.75 109.85 o
-3 9 -12 158.98 249.53 131.18 o
-2 9 -12 42.54 103.57 147.90 o
0 1 -11 4108.20 4152.78 63.37 o
0 2 -11 1317.14 1396.25 63.48 o
-1 3 -11 2858.63 2777.73 41.64 o
0 3 -11 2296.86 2252.00 66.05 o
-1 4 -11 168.29 84.17 35.96 o
0 4 -11 749.25 707.04 59.71 o
-2 5 -11 8146.20 8191.79 74.07 o
-1 5 -11 875.33 815.85 46.50 o
0 5 -11 4137.63 4069.98 89.50 o
-2 6 -11 3765.20 3615.66 73.16 o
-1 6 -11 632.98 620.93 60.79 o
0 6 -11 293.73 135.43 85.77 o
-3 7 -11 150.28 208.04 82.29 o
-2 7 -11 1866.52 1832.83 80.15 o
-1 7 -11 148.70 142.41 82.90 o
0 7 -11 1810.19 1759.23 132.27 o
-3 8 -11 709.89 609.04 114.46 o
-2 8 -11 400.72 536.16 93.10 o
-1 8 -11 57.04 116.73 91.91 o
0 8 -11 8370.31 8430.82 208.64 o
-4 9 -11 183.78 -1.22 109.14 o
-3 9 -11 216.79 217.38 120.32 o
-2 9 -11 195.39 207.53 117.82 o
-1 9 -11 1425.36 1371.92 142.41 o
-4 10 -11 1412.19 1470.30 153.12 o
0 0 -10 499.98 675.08 117.52 o
0 1 -10 2137.31 2117.62 41.09 o
-1 2 -10 1257.17 1238.54 37.45 o
0 2 -10 35676.87 36558.81 184.62 o
-1 3 -10 6194.76 6068.48 50.24 o
0 3 -10 751.33 713.14 50.04 o
-2 4 -10 167.83 132.60 41.39 o
-1 4 -10 4337.00 4253.51 50.69 o
0 4 -10 4827.16 4730.41 82.13 o
-2 5 -10 1160.84 1222.61 42.41 o
-1 5 -10 1023.73 903.45 36.96 o
0 5 -10 13896.91 14084.02 144.25 o
-3 6 -10 2890.09 2816.80 90.46 o
-2 6 -10 2270.20 2235.71 51.83 o
-1 6 -10 4420.02 4336.79 62.90 o
0 6 -10 1030.11 1169.29 83.89 o
-3 7 -10 3143.71 3005.79 75.91 o
-2 7 -10 444.56 432.46 62.29 o
-1 7 -10 1249.60 1282.79 67.06 o
0 7 -10 1133.18 1262.78 105.21 o
-4 8 -10 839.29 952.53 99.30 o
-3 8 -10 11580.91 11733.57 124.08 o
-2 8 -10 1725.07 1861.55 77.41 o
-1 8 -10 1042.86 1136.23 96.20 o
0 8 -10 667.54 772.93 125.73 o
-4 9 -10 463.14 316.08 87.33 o
-3 9 -10 271.29 301.94 86.30 o
-2 9 -10 833.20 988.44 100.57 o
-1 9 -10 337.39 321.54 120.92 o
0 9 -10 823.54 1079.10 221.07 o
-5 10 -10 1252.71 836.70 178.69 o
-4 10 -10 442.32 263.06 143.97 o
-3 10 -10 3818.75 3596.39 191.98 o
-2 10 -10 389.34 505.88 139.49 o
0 1 -9 1732.86 1730.99 30.14 o
0 2 -9 2359.66 2358.03 32.81 o
-1 3 -9 1619.89 1577.57 23.18 o
0 3 -9 140.33 143.40 38.28 o
-1 4 -9 163.13 209.11 26.67 o
0 4 -9 1362.94 1328.99 59.96 o
-2 5 -9 3412.59 3421.37 50.51 o
-1 5 -9 8.30 -4.68 29.29 o
0 5 -9 1641.44 1590.34 58.10 o
-2 6 -9 710.31 684.36 43.22 o
-1 6 -9 1276.58 1243.87 42.64 o
0 6 -9 145.22 171.31 71.02 o
-3 7 -9 59.36 136.40 55.21 o
-2 7 -9 47.38 55.41 47.59 o
-1 7 -9 218.63 264.14 59.46 o
0 7 -9 442.29 502.63 92.81 o
-3 8 -9 1523.57 1504.81 72.96 o
-2 8 -9 561.55 664.08 80.60 o
-1 8 -9 49.01 161.98 73.70 o
0 8 -9 2710.45 2465.51 125.64 o
-4 9 -9 26.63 -16.96 76.21 o
-3 9 -9 290.00 201.06 82.08 o
-2 9 -9 191.62 162.62 96.94 o
-1 9 -9 350.07 65.35 98.85 o
0 9 -9 115.65 -42.09 190.51 o
-4 10 -9 297.55 437.70 107.35 o
-3 10 -9 394.05 441.16 114.89 o
-2 10 -9 31.17 98.38 126.79 o
0 0 -8 44911.69 45481.83 513.69 o
0 1 -8 1288.11 1271.89 21.37 o
-1 2 -8 1619.20 1605.67 24.65 o
0 2 -8 1415.53 1461.79 25.58 o
-1 3 -8 2217.54 2192.04 23.25 o
0 3 -8 7308.32 7400.58 77.64 o
-2 4 -8 8059.97 8152.15 73.67 o
-1 4 -8 181.61 146.05 23.50 o
0 4 -8 1035.07 1024.29 34.30 o
-2 5 -8 2531.28 2488.54 36.75 o
-1 5 -8 156.59 141.66 32.96 o
0 5 -8 2622.36 2546.31 52.65 o
-3 6 -8 7402.00 7428.49 102.49 o
-2 6 -8 116.48 83.52 40.26 o
-1 6 -8 1126.51 1140.23 37.09 o
0 6 -8 2591.74 2482.15 75.01 o
-3 7 -8 763.46 722.21 49.88 o
-2 7 -8 2165.39 2063.94 56.64 o
-1 7 -8 104.36 162.33 48.42 o
0 7 -8 701.21 775.38 103.44 o
-4 8 -8 2046.41 2128.19 94.57 o
-3 8 -8 864.32 875.21 62.98 o
-2 8 -8 408.72 334.73 64.03 o
-1 8 -8 1927.78 1925.57 74.65 o
0 8 -8 1399.50 1050.13 126.70 o
-4 9 -8 12.85 112.80 70.20 o
-3 9 -8 923.34 955.35 74.12 o
-2 9 -8 609.38 711.06 76.90 o
-1 9 -8 355.87 341.95 111.95 o
0 9 -8 348.77 438.94 141.19 o
-5 10 -8 4703.81 4653.32 159.98 o
-4 10 -8 143.02 209.08 89.88 o
-3 10 -8 581.39 618.34 100.03 o
-2 10 -8 1139.96 853.49 136.79 o
-1 10 -8 154.05 1.30 155.92 o
-5 11 -8 607.56 628.04 119.83 o
-4 11 -8 65.17 -45.78 129.37 o
0 1 -7 2056.26 2003.88 20.95 o
0 2 -7 1217.71 1219.57 19.74 o
-1 3 -7 5224.63 5165.20 33.60 o
0 3 -7 28776.71 29542.96 168.46 o
-1 4 -7 3295.80 3336.68 39.34 o
0 4 -7 5808.99 5956.21 69.55 o
-2 5 -7 7435.36 7421.93 53.40 o
-1 5 -7 2905.09 2854.46 36.90 o
0 5 -7 10752.00 10852.24 95.45 o
-2 6 -7 1220.23 1297.86 41.63 o
-1 6 -7 588.47 592.04 31.68 o
0 6 -7 9646.39 9556.18 101.20 o
-3 7 -7 1480.32 1402.42 47.54 o
-2 7 -7 2874.83 2906.29 52.93 o
-1 7 -7 494.65 465.13 47.00 o
0 7 -7 5013.17 4928.13 95.21 o
-3 8 -7 1762.36 1685.12 60.87 o
-2 8 -7 7573.64 7556.99 95.20 o
-1 8 -7 677.98 684.32 64.91 o
0 8 -7 201.30 240.82 103.04 o
-4 9 -7 308.38 380.05 65.99 o
-3 9 -7 4391.55 4200.41 87.43 o
-2 9 -7 280.28 279.52 69.68 o
-1 9 -7 204.42 161.01 81.22 o
0 9 -7 81.38 102.20 134.94 o
-4 10 -7 109.97 72.82 94.40 o
-3 10 -7 208.39 156.32 83.34 o
-2 10 -7 4893.82 4964.88 113.89 o
-1 10 -7 38.92 46.84 126.56 o
-5 11 -7 208.07 107.94 111.44 o
-4 11 -7 2583.90 2727.56 168.71 o
-3 11 -7 1209.63 1241.29 136.30 o
0 0 -6 106141.59 103251.95 816.29 o
0 1 -6 6595.31 6564.79 31.28 o
-1 2 -6 5507.55 5514.18 34.54 o
0 2 -6 4777.60 4692.19 33.73 o
-1 3 -6 1068.23 1022.72 16.22 o
0 3 -6 14088.83 14261.85 127.29 o
-2 4 -6 15252.25 15432.81 112.43 o
-1 4 -6 1276.46 1241.27 23.58 o
0 4 -6 1812.76 1762.82 43.82 o
-2 5 -6 9228.51 9358.64 57.63 o
-1 5 -6 1970.25 1991.73 37.72 o
0 5 -6 1206.81 1220.29 46.95 o
-3 6 -6 16066.17 16314.13 158.50 o
-2 6 -6 2819.74 2805.67 49.30 o
-1 6 -6 1427.22 1379.22 39.07 o
0 6 -6 106.92 85.09 45.03 o
-3 7 -6 81.63 40.74 31.42 o
-2 7 -6 4428.40 4389.10 59.58 o
-1 7 -6 656.96 569.64 42.91 o
0 7 -6 3468.07 3479.80 98.68 o
-4 8 -6 271.60 325.61 93.60 o
-3 8 -6 1561.38 1501.84 61.01 o
-2 8 -6 481.14 504.75 62.48 o
-1 8 -6 4100.26 3950.40 70.00 o
0 8 -6 4703.77 4510.97 118.72 o
-4 9 -6 1057.86 982.08 70.40 o
-3 9 -6 1659.73 1750.82 71.21 o
-2 9 -6 285.53 223.52 64.51 o
-1 9 -6 233.76 229.00 97.81 o
0 9 -6 1514.57 1347.66 141.80 o
-5 10 -6 8291.38 8279.59 175.39 o
-4 10 -6 1386.74 1521.01 92.74 o
-3 10 -6 587.24 526.60 110.52 o
-2 10 -6 492.76 447.58 97.95 o
-1 10 -6 209.42 209.60 100.25 o
0 10 -6 197.90 498.18 241.75 o
-5 11 -6 580.59 515.96 106.78 o
-4 11 -6 631.54 467.99 105.91 o
-3 11 -6 183.31 296.87 129.21 o
-2 11 -6 555.48 664.14 270.39 o
0 1 -5 6281.44 6212.14 28.91 o
0 2 -5 3215.84 3205.84 29.02 o
-1 3 -5 189.14 174.36 10.98 o
0 3 -5 2601.77 2638.44 38.65 o
-1 4 -5 124.75 102.23 16.58 o
0 4 -5 602.10 585.85 28.65 o
-2 5 -5 6316.47 6413.80 48.79 o
-1 5 -5 303.61 302.49 23.40 o
0 5 -5 189.76 123.48 36.51 o
-2 6 -5 794.54 793.81 29.67 o
-1 6 -5 743.28 739.24 35.76 o
0 6 -5 762.73 729.34 51.33 o
-3 7 -5 298.44 254.83 36.05 o
-2 7 -5 400.27 333.31 35.08 o
-1 7 -5 9.77 62.70 38.12 o
0 7 -5 1050.73 1031.31 62.14 o
-3 8 -5 1119.46 1089.69 48.55 o
-2 8 -5 17.48 -0.59 48.44 o
-1 8 -5 54.87 87.77 49.45 o
0 8 -5 2540.50 2443.97 95.21 o
-4 9 -5 148.22 106.54 70.95 o
-3 9 -5 412.15 485.54 65.25 o
-2 9 -5 106.05 90.90 66.95 o
-1 9 -5 623.19 729.82 76.04 o
0 9 -5 107.09 286.00 150.22 o
-4 10 -5 295.50 310.23 90.63 o
-3 10 -5 190.81 272.42 82.54 o
-2 10 -5 273.76 110.99 88.10 o
-1 10 -5 14.06 190.46 95.85 o
0 10 -5 48.33 272.09 260.90 o
-5 11 -5 1278.59 1132.17 110.40 o
-4 11 -5 188.12 373.88 123.58 o
-3 11 -5 14.95 -48.88 129.11 o
-2 11 -5 225.70 140.12 171.12 o
0 0 -4 3979.73 4048.18 53.88 o
0 1 -4 15517.74 15832.12 54.14 o
-1 2 -4 888.68 883.38 12.60 o
0 2 -4 39511.31 39506.61 142.34 o
-1 3 -4 32470.50 32209.90 108.81 o
0 3 -4 1812.49 1803.08 28.18 o
-2 4 -4 4565.21 4618.41 62.33 o
-1 4 -4 1606.91 1577.40 23.42 o
0 4 -4 341.13 349.89 32.55 o
-2 5 -4 2367.09 2295.46 27.69 o
-1 5 -4 207.92 219.89 20.76 o
0 5 -4 41332.11 41798.13 296.01 o
-3 6 -4 340.86 305.38 39.75 o
-2 6 -4 23.78 1.02 28.70 o
-1 6 -4 2246.19 2230.87 40.54 o
0 6 -4 4789.57 4722.15 79.63 o
-3 7 -4 11818.45 12057.79 84.01 o
-2 7 -4 458.04 437.88 28.06 o
-1 7 -4 141.01 136.31 35.35 o
0 7 -4 154.83 154.24 65.05 o
-4 8 -4 3709.75 3785.12 95.42 o
-3 8 -4 8496.69 8603.94 75.16 o
-2 8 -4 6770.66 6797.48 75.46 o
-1 8 -4 30.49 16.78 51.00 o
0 8 -4 440.93 385.24 82.84 o
-4 9 -4 1886.47 1933.62 80.86 o
-3 9 -4 258.96 209.91 68.55 o
-2 9 -4 4294.38 4314.02 79.80 o
-1 9 -4 664.60 704.83 64.80 o
0 9 -4 39.94 -103.47 103.47 o
-5 10 -4 114.72 -94.78 115.02 o
-4 10 -4 418.84 382.64 83.39 o
-3 10 -4 1814.97 1872.82 90.77 o
-2 10 -4 1686.37 1931.99 94.00 o
-1 10 -4 16.46 -106.75 106.75 o
0 10 -4 4539.00 4337.79 217.64 o
-5 11 -4 2455.04 2556.46 115.00 o
-4 11 -4 38.50 -11.08 102.73 o
-3 11 -4 3814.79 3602.38 126.34 o
-2 11 -4 943.43 1018.91 148.15 o
-6 12 -4 536.54 601.33 206.72 o
0 1 -3 7522.59 7746.22 30.49 o
0 2 -3 893.46 860.30 13.87 o
-1 3 -3 19669.79 19850.75 57.24 o
0 3 -3 9116.62 8963.82 58.60 o
-1 4 -3 348.37 368.27 15.93 o
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